C202-1567 Screening compound: methyl 8-oxo-9-[4-(propan-2-yl)phenyl]-4H,5H,6H,7H,8H,9H-[1,2,4]triazolo[3,2-b]quinazoline-2-carboxylate

C202-1567 Screening compound: methyl 8-oxo-9-[4-(propan-2-yl)phenyl]-4H,5H,6H,7H,8H,9H-[1,2,4]triazolo[3,2-b]quinazoline-2-carboxylate
C202-1567 Screening compound: methyl 8-oxo-9-[4-(propan-2-yl)phenyl]-4H,5H,6H,7H,8H,9H-[1,2,4]triazolo[3,2-b]quinazoline-2-carboxylate alternative view

Chemical Structure Depiction of ChemDiv screening compound C202-1567
methyl 8-oxo-9-[4-(propan-2-yl)phenyl]-4H,5H,6H,7H,8H,9H-[1,2,4]triazolo[3,2-b]quinazoline-2-carboxylate

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

C202-1567

Molecular Formula

C20H22N4O3 (C20 H22 N4 O3)

Compound Name

methyl 8-oxo-9-[4-(propan-2-yl)phenyl]-4H,5H,6H,7H,8H,9H-[1,2,4]triazolo[3,2-b]quinazoline-2-carboxylate

IUPAC name

methyl 8-oxo-9-[4-(propan-2-yl)phenyl]-4H5H6H7H8H9H-[124]triazolo[32-b]quinazoline-2-carboxylate

SMILES

CC(C)c1ccc(C2n3nc(C(OC)=O)nc3NC(CCC3)=C2C3=O)cc1

InChI

InChI=1S/C20H22N4O3/c1-11(2)12-7-9-13(10-8-12)17-16-14(5-4-6-15(16)25)21-20-22-18(19(26)27-3)23-24(17)20/h7-11,17H,4-6H2,1-3H3,(H,21,22,23)/t17-/m0/s1

InChI Key

SAEYZQXEUUDAEA-KRWDZBQOSA-N

MDL Number (MFCD)

MFCD14730494

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

366.42

Hydrogen Bond Acceptors Count

7.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

4.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

3.631

Distribution Coefficient, logD

2.935

Water Solubility, LogSw

-3.91

Polar Surface Area

71.790

Acid Dissociation Constant (pKa)

6.80

Base Dissociation Constant (pKb)

-5.08

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

40.00

C202-1567 in Drug Discovery

Included in Screening Libraries

Protein-Protein Interaction Library (218420 compounds)

Beyond the Flatland Library sp3 enriched (92988 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Mechanism of action:
  • PPI modulators
Structure:
  • Cyclic compounds

References: we are preparing a list of scientific research reports with C202-1567 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound C202-1567?
Check Price and Availability of C202-1567, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of C202-1567 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for C202-1567
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for C202-1567
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of C202-1567 available by request